1-(2-chlorophenyl)-2-[(4-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
1-(2-chlorophenyl)-2-[(4-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
1-(2-chlorophenyl)-2-[(4-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V001-7496 |
| Compound Name: | 1-(2-chlorophenyl)-2-[(4-nitrophenyl)methyl]-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 381.86 |
| Molecular Formula: | C21 H20 Cl N3 O2 |
| Smiles: | C1CN(Cc2ccc(cc2)[N+]([O-])=O)C(c2ccccc2[Cl])c2cccn2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0148 |
| logD: | 5.0095 |
| logSw: | -5.202 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.323 |
| InChI Key: | JSBBXCZYHPOXOA-OAQYLSRUSA-N |